4B6O

Structure of Mycobacterium tuberculosis Type II Dehydroquinase inhibited by (2S)-2-(4-methoxy)benzyl-3-dehydroquinic acid

4B6O の概要

• エントリーDOI: 10.2210/pdb4b6o/pdb
• 関連するPDBエントリー: 1H05 1H0R 1H0S 2DHQ 2XB8 2Y71 2Y76 2Y77 4B6P 4B6Q 4B6R 4B6S
• 分子名称: 3-DEHYDROQUINATE DEHYDRATASE, (1R,2S,4S,5R)-2-(4-methoxyphenyl)methyl-1,4,5-trihydroxy-3-oxocyclohexane-1-carboxylic acid, SULFATE ION, ... (4 entities in total)
• 機能のキーワード: lyase, inhibitor
• 由来する生物種: MYCOBACTERIUM TUBERCULOSIS
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 16371.29

構造登録者

Otero, J.M.,Llamas-Saiz, A.L.,Lence, E.,Tizon, L.,Peon, A.,Prazeres, V.F.V.,Lamb, H.,Hawkins, A.R.,Gonzalez-Bello, C.,van Raaij, M.J. (登録日: 2012-08-14, 公開日: 2012-12-19, 最終更新日: 2023-12-20)

• 主引用文献: Lence, E.,Tizon, L.,Otero, J.M.,Peon, A.,Prazeres, V.F.,Llamas-Saiz, A.L.,Fox, G.C.,van Raaij, M.J.,Lamb, H.,Hawkins, A.R.,Gonzalez-Bello, C.; Mechanistic basis of the inhibition of type II dehydroquinase by (2S)- and (2R)-2-benzyl-3-dehydroquinic acids.; ACS Chem. Biol., 8:568-577, 2013; PubMed: 23198883; DOI: 10.1021/cb300493s

実験手法

X-RAY DIFFRACTION (2 Å)